SEQ2FUN

BioLiP

PDB CCD ID: A1AYI
Number of entries in BioLiP: 1
Chemical formula: C13 H12 O2
InChI: InChI=1S/C13H12O2/c14-10-11-6-4-5-9-13(11)15-12-7-2-1-3-8-12/h1-9,14H,10H2
InChIKey: VMZBMTWFHYYOIN-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1ccc(cc1)Oc2ccccc2CO
CACTVS 3.385OCc1ccccc1Oc2ccccc2
ACDLabs 12.01OCc1ccccc1Oc1ccccc1
Name:(2-phenoxyphenyl)methanol
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).